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5-(6-azanyl-1,3-benzothiazol-2-yl)pentanoic acid

5-(6-azanyl-1,3-benzothiazol-2-yl)pentanoic acid

Systemtic Name:5-(6-azanyl-1,3-benzothiazol-2-yl)pentanoic acid
Openeye Name:5-(6-amino-1,3-benzothiazol-2-yl)pentanoic acid
CAS Name:5-(6-amino-1,3-benzothiazol-2-yl)pentanoic acid
IUPAC Name:5-(6-amino-1,3-benzothiazol-2-yl)pentanoic acid
Traditional Name:5-(6-amino-1,3-benzothiazol-2-yl)valeric acid
Formula: C12H14N2O2S
MolecularWeight: 250.31676
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1N)SC(=N2)CCCCC(=O)O


Isomeric SMILES

C1=CC2=C(C=C1N)SC(=N2)CCCCC(=O)O


InChI

InChI=1S/C12H14N2O2S/c13-8-5-6-9-10(7-8)17-11(14-9)3-1-2-4-12(15)16/h5-7H,1-4,13H2,(H,15,16)


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